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BDBM50306464 5-fluoro-3-(1-(2-(5-methoxybenzofuran-3-yl)ethyl)-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole::CHEMBL599066

SMILES: COc1ccc2occ(CCN3CCC(=CC3)c3c[nH]c4ccc(F)cc34)c2c1

InChI Key: InChIKey=NSMZOIQJWZNXFF-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50306464   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50306464
PNG
(5-fluoro-3-(1-(2-(5-methoxybenzofuran-3-yl)ethyl)-...)
Show SMILES COc1ccc2occ(CCN3CCC(=CC3)c3c[nH]c4ccc(F)cc34)c2c1 |c:14|
Show InChI InChI=1S/C24H23FN2O2/c1-28-19-3-5-24-20(13-19)17(15-29-24)8-11-27-9-6-16(7-10-27)22-14-26-23-4-2-18(25)12-21(22)23/h2-6,12-15,26H,7-11H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
54n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]paroxetine from 5-HT transporter in rat frontal cortical synaptosomes


Bioorg Med Chem Lett 20: 824-7 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.093
BindingDB Entry DOI: 10.7270/Q2B56JVJ
More data for this
Ligand-Target Pair